CS-0908159
(1R,2S,5S)-6-Benzyl-3-oxa-6-azabicyclo[3.1.1]heptane-2-carboxylic acid hydrochloride
Manufacturer: ChemScene
CAS Number: 2997009-96-6
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Purity
98%
MDL No
None
Storage
Sealed in dry,2-8℃
Shipping
Room temperature in continental US; may vary elsewhere.
Molecular Formula
C₁₃H₁₆ClNO₃
Molecular Weight
269.72
Synonyms
None
SMILES
OC([C@@H](OC[C@]1([H])C2)[C@]2([H])N1CC3=CC=CC=C3)=O.Cl
Tpsa
49.77
Logp
1.5347
H Acceptors
3
H Donors
1
Rotatable Bonds
3
SAFETY INFORMATION
Pictograms
Signal Word
Warning
UN Number
N/A
Class
N/A
Packing Group
N/A
Hazard Statements
Precautionary Statements
P261-P264-P270-P271-P280-P302+P352-P304+P340-P305+P351+P338-P330-P362+P364-P403+P233-P405-P501
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Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₃H₁₆ClNO₃
Molecular Weight: 269.72
Synonyms: None
SMILES: OC([C@@H](OC[C@]1([H])C2)[C@]2([H])N1CC3=CC=CC=C3)=O.Cl
Tpsa: 49.77
Logp: 1.5347
H Acceptors: 3
H Donors: 1
Rotatable Bonds: 3
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₃H₁₆ClNO₃
Molecular Weight:
269.72
Synonyms:
None
SMILES:
OC([C@@H](OC[C@]1([H])C2)[C@]2([H])N1CC3=CC=CC=C3)=O.Cl
Tpsa:
49.77
Logp:
1.5347
H Acceptors:
3
H Donors:
1
Rotatable Bonds:
3
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₉H₁₆ClF₂NO
Molecular Weight: 227.68
Synonyms: None
SMILES: OCC1(C2(F)F)CNCC2CCC1.Cl
Tpsa: 32.26
Logp: 1.4255
H Acceptors: 2
H Donors: 2
Rotatable Bonds: 1
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₉H₁₆ClF₂NO
Molecular Weight:
227.68
Synonyms:
None
SMILES:
OCC1(C2(F)F)CNCC2CCC1.Cl
Tpsa:
32.26
Logp:
1.4255
H Acceptors:
2
H Donors:
2
Rotatable Bonds:
1
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₀H₈Cl₂N₂
Molecular Weight: 227.09
Synonyms: None
SMILES: CCC1=CC=NC2=CC(Cl)=NC(Cl)=C12
Tpsa: 25.78
Logp: 3.499
H Acceptors: 2
H Donors: 0
Rotatable Bonds: 1
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₀H₈Cl₂N₂
Molecular Weight:
227.09
Synonyms:
None
SMILES:
CCC1=CC=NC2=CC(Cl)=NC(Cl)=C12
Tpsa:
25.78
Logp:
3.499
H Acceptors:
2
H Donors:
0
Rotatable Bonds:
1
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₉H₆Cl₂N₂O
Molecular Weight: 229.06
Synonyms: None
SMILES: COC1=CC=NC2=CC(Cl)=NC(Cl)=C12
Tpsa: 35.01
Logp: 2.9452
H Acceptors: 3
H Donors: 0
Rotatable Bonds: 1
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₉H₆Cl₂N₂O
Molecular Weight:
229.06
Synonyms:
None
SMILES:
COC1=CC=NC2=CC(Cl)=NC(Cl)=C12
Tpsa:
35.01
Logp:
2.9452
H Acceptors:
3
H Donors:
0
Rotatable Bonds:
1